0 mol 8 unq 0 iso 0 dist 9.36227 7.46102 8.79328 10.4489 14.0444 8.53529 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.36227 9.91301 8.5845 10.4489 14.0444 7.18019 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 9.25641 9.96265 16.532 12.8967 21.1598 9.6782 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 9.5915 5.97635 9.88291 11.5332 11.3153 7.21717 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.59503 8.4545 4.73713 12.49 5.93987 8.18107 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 9.59503 8.4545 4.73713 4.1125 7.7913 5.9465 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 9.59503 7.01176 4.36394 12.49 5.93987 9.8859 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 9.59503 7.01176 4.36394 4.1125 7.7913 6.97962 numMergedOcc 0
8 mol 92 unq 4 iso 0 dist 9.61119 8.4545 9.29076 12.49 12.8217 8.18107 numMergedOcc 0
9 mol 92 unq 5 iso 0 dist 9.61119 8.4545 9.29076 4.1125 10.8438 5.9465 numMergedOcc 0
10 mol 92 unq 6 iso 0 dist 9.61119 7.01176 4.39652 12.49 12.8217 9.8859 numMergedOcc 0
11 mol 92 unq 7 iso 0 dist 9.61119 7.01176 4.39652 4.1125 10.8438 6.97962 numMergedOcc 0
12 mol 113 unq 0 iso 0 dist 9.64281 8.89481 14.0364 11.2266 9.09263 8.8822 numMergedOcc 0
13 mol 113 unq 1 iso 0 dist 9.64281 8.89481 14.0364 9.01097 5.37302 9.66219 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 7.72434 6.40546 6.0968 5.73999 12.3696 8.99399 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 7.12336 9.50322 6.26797 16.7326 14.2733 9.22232 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 7.12336 9.50322 6.26797 10.2948 6.42904 9.22661 numMergedOcc 0
17 mol 133 unq 2 iso 0 dist 7.12336 9.50322 6.26797 11.6924 10.0298 7.56378 numMergedOcc 0
18 mol 155 unq 0 iso 0 dist 6.91762 4.44292 5.01007 5.45915 10.463 6.53347 numMergedOcc 0
19 mol 163 unq 0 iso 0 dist 9.04757 9.63873 4.12904 6.09134 9.62943 9.07943 numMergedOcc 0
20 mol 171 unq 0 iso 0 dist 8.59783 6.07091 9.22906 4.98945 6.21194 9.61462 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 5.75545 9.58911 8.58814 12.0718 10.9891 6.22122 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 7.50665 7.50424 5.44171 11.2248 9.19443 6.30154 numMergedOcc 0
23 mol 234 unq 1 iso 0 dist 7.50665 7.50424 5.44171 10.6488 12.5134 7.32499 numMergedOcc 0
24 mol 235 unq 0 iso 0 dist 8.92054 9.11256 5.23741 3.93066 10.8785 9.55668 numMergedOcc 0
25 mol 237 unq 0 iso 0 dist 9.18638 9.42743 15.4677 11.5107 17.2533 6.99315 numMergedOcc 0
26 mol 244 unq 0 iso 0 dist 5.06669 7.65388 11.6777 4.38246 8.08939 5.50492 numMergedOcc 0
27 mol 244 unq 1 iso 0 dist 5.65248 7.65388 7.45211 4.38246 7.33574 5.50492 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 6.40339 6.37672 9.9244 4.20164 6.58109 5.48118 numMergedOcc 0
29 mol 251 unq 0 iso 0 dist 8.89433 8.39644 12.3975 4.01393 11.7846 8.68707 numMergedOcc 0
30 mol 258 unq 0 iso 0 dist 8.37512 9.59174 8.27707 5.32742 8.63176 9.63959 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 9.05363 8.06771 10.4985 5.61261 13.1095 7.98231 numMergedOcc 0
32 mol 259 unq 1 iso 0 dist 7.34794 9.54857 5.41945 8.74892 8.90398 7.08526 numMergedOcc 0
33 mol 265 unq 0 iso 0 dist 9.71346 7.04833 6.50018 10.7881 11.1092 6.71375 numMergedOcc 0
34 mol 292 unq 0 iso 0 dist 8.35169 7.53641 8.04474 8.46139 13.7647 7.07965 numMergedOcc 0
35 mol 292 unq 1 iso 0 dist 7.7557 7.53641 9.00118 8.46139 10.0972 7.07965 numMergedOcc 0
